General Information of the Compound
| Compound ID |
CP0360921
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| Compound Name |
2-(dimethylamino)ethyl (E)-3-[3-[(4-methylphenyl)carbamoyl]-4-oxochromen-6-yl]prop-2-enoate
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| Structure |
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| Formula |
C24H24N2O5
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| Molecular Weight |
420.465
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| Canonical SMILES |
CN(C)CCOC(=O)\C=C\c1ccc2occ(C(=O)Nc3ccc(C)cc3)c(=O)c2c1
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| InChI |
InChI=1S/C24H24N2O5/c1-16-4-8-18(9-5-16)25-24(29)20-15-31-21-10-6-17(14-19(21)23(20)28)7-11-22(27)30-13-12-26(2)3/h4-11,14-15H,12-13H2,1-3H3,(H,25,29)/b11-7+
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| InChIKey |
FIOCFZWNVLEJQA-YRNVUSSQSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound